rel-(3aR,5S,6aR)-2-benzyl-5-({5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}amino)-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,5S,6aR)-2-benzyl-5-({5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}amino)-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
rel-(3aR,5S,6aR)-2-benzyl-5-({5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}amino)-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | SD64-0508 |
| Compound Name: | rel-(3aR,5S,6aR)-2-benzyl-5-({5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}amino)-N-methylhexahydrocyclopenta[c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 447.54 |
| Molecular Formula: | C25 H29 N5 O3 |
| Smiles: | [H][C@]12C[C@@H](C[C@@]2(CN(Cc2ccccc2)C1)C(NC)=O)NC(c1ccc(Cn2ccnc2)o1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7062 |
| logD: | -1.5802 |
| logSw: | -1.8838 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.664 |
| InChI Key: | DXBDXSRGPLQOLJ-RNHFSVANSA-N |